ATOM 43
1 C1x C 20.3597 -23.2927
2 O7x O 20.3597 -24.6958
3 C7x C 21.5747 -25.3973
4 C2y C 22.7899 -24.6958
5 C1z C 22.7899 -23.2927
6 C1x C 21.5747 -22.5912
7 C2x C 24.0050 -25.3973
8 O2x O 25.2201 -24.6958
9 C1y C 25.2201 -23.2927
10 C1y C 24.0050 -22.5912
11 O6a O 21.5747 -26.8002
12 O1a O 22.7899 -21.8896
13 C2b C 24.0050 -21.1881
14 C2a C 25.2222 -20.4853
15 O2a O 26.4203 -22.5997
16 C1y C 27.6354 -23.3012
17 O2x O 27.6356 -24.6957
18 C1y C 28.8508 -25.3970
19 C1y C 30.0658 -24.6954
20 C1y C 30.0657 -23.3010
21 C1y C 28.8505 -22.5996
22 O7a O 28.8505 -21.1965
23 C7a C 30.0677 -20.4937
24 O6a O 31.2596 -21.1820
25 C8y C 30.0679 -19.0837
26 C8y C 31.2629 -18.3937
27 C8x C 31.2629 -16.9906
28 C8y C 30.0477 -16.2891
29 C8x C 28.8527 -16.9791
30 C8y C 28.8528 -18.3822
31 C8y C 32.4509 -19.0797
32 C8x C 32.4508 -20.4863
33 C8y C 33.6660 -21.1879
34 C8x C 34.8811 -20.4863
35 C8x C 34.8811 -19.0797
36 C8x C 33.6660 -18.3782
37 O1a O 33.6659 -22.5910
38 O1a O 27.6345 -19.0855
39 O1a O 30.0478 -14.8741
40 C1b C 28.8509 -26.8004
41 O1a O 31.2656 -22.6078
42 O1a O 31.2624 -25.3863
43 O1a O 30.0642 -27.5008
BOND 47
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 2
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 3 11 2
13 5 12 1 #Down
14 10 13 1 #Up
15 13 14 2
16 9 15 1 #Down
17 16 15 1 #Up
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 16 21 1
24 21 22 1 #Down
25 22 23 1
26 23 24 2
27 23 25 1
28 25 26 2
29 26 27 1
30 27 28 2
31 28 29 1
32 29 30 2
33 25 30 1
34 26 31 1
35 31 32 2
36 32 33 1
37 33 34 2
38 34 35 1
39 35 36 2
40 31 36 1
41 33 37 1
42 30 38 1
43 28 39 1
44 18 40 1 #Up
45 20 41 1 #Up
46 19 42 1 #Down
47 40 43 1
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